U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C13H16O2
Molecular Weight 204.2649
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOHEXYL BENZOATE

SMILES

O=C(OC1CCCCC1)C2=CC=CC=C2

InChI

InChIKey=DQZKGSRJOUYVPL-UHFFFAOYSA-N
InChI=1S/C13H16O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2

HIDE SMILES / InChI

Molecular Formula C13H16O2
Molecular Weight 204.2649
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 17:20:04 GMT 2025
Edited
by admin
on Tue Apr 01 17:20:04 GMT 2025
Record UNII
D78VJ3UF7P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLOHEXYL BENZOATE
Systematic Name English
BENZOIC ACID, CYCLOHEXYL ESTER
Preferred Name English
Code System Code Type Description
EPA CompTox
DTXSID90178843
Created by admin on Tue Apr 01 17:20:04 GMT 2025 , Edited by admin on Tue Apr 01 17:20:04 GMT 2025
PRIMARY
PUBCHEM
75486
Created by admin on Tue Apr 01 17:20:04 GMT 2025 , Edited by admin on Tue Apr 01 17:20:04 GMT 2025
PRIMARY
ECHA (EC/EINECS)
219-319-3
Created by admin on Tue Apr 01 17:20:04 GMT 2025 , Edited by admin on Tue Apr 01 17:20:04 GMT 2025
PRIMARY
FDA UNII
D78VJ3UF7P
Created by admin on Tue Apr 01 17:20:04 GMT 2025 , Edited by admin on Tue Apr 01 17:20:04 GMT 2025
PRIMARY
CAS
2412-73-9
Created by admin on Tue Apr 01 17:20:04 GMT 2025 , Edited by admin on Tue Apr 01 17:20:04 GMT 2025
PRIMARY